N-ethyl-2-(pentanoylcarbamothioylamino)-N-phenyl-benzamide

Systemtic Name: N-ethyl-2-(pentanoylcarbamothioylamino)-N-phenyl-benzamide Openeye Name: N-ethyl-2-(pentanoylcarbamothioylamino)-N-phenyl-benzamide CAS Name: N-ethyl-2-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-2-(pentanoylcarbamothioylamino)-N-phenylbenzamide Traditional Name: N-ethyl-N-phenyl-2-(valerylthiocarbamoylamino)benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(CC)C2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N(CC)C2=CC=CC=C2

InChI

InChI=1S/C21H25N3O2S/c1-3-5-15-19(25)23-21(27)22-18-14-10-9-13-17(18)20(26)24(4-2)16-11-7-6-8-12-16/h6-14H,3-5,15H2,1-2H3,(H2,22,23,25,27)